COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK454461
Chemical Name: methyl5-{[(6-chloro-2-oxo-2H-chromen-3-yl)carbonyl]amino}-4-cyano-3-methylthiophene-2-carboxylate
Smiles: COC(=O)c1sc(c(c1C)C#N)NC(=O)c1cc2cc(Cl)ccc2oc1=O

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Molecular Weight: 402.81
Empirical Formula: C18H11ClN2O5S

Physical State: Dry powder
Available Amount: 163 mg

Lipinsky:
logP: 4.595
Rotatable bonds: 3
H-donors: 1
H-acceptors: 5
PSA: 133
Number of rings: 3

     

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